SCHEMBL31565227

SCHEMBL31565227

CC1(O)CN(c2ccnc(C(=O)Nc3cccc4cccnc34)c2)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ TNKS O95271 2/20 0.49
▸ TNKS2 Q9H2K2 2/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.48
▸ MAPT P10636 2/20 0.48
▸ TP53 P04637 1/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ SENP8 Q96LD8 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ SENP6 Q9GZR1 1/20 0.48
▸ KDR P35968 6/20 0.48
▸ GAA P10253 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31565266 0.93 ALDH1A1 (0.53) HPGDALDH1A1HTTSMN1; SMN2TNKS
SCHEMBL31565210 0.91 ALDH1A1 (0.55) HPGDALDH1A1HTTSMN1; SMN2TNKS
SCHEMBL31565212 0.90 ALDH1A1 (0.51) HPGDALDH1A1HTTSMN1; SMN2TNKS
SCHEMBL31565292 0.88 HTT (0.52) HPGDALDH1A1HTTSMN1; SMN2TNKS
SCHEMBL31565262 0.88 ALDH1A1 (0.53) HPGDALDH1A1HTTSMN1; SMN2TNKS
SCHEMBL31565191 0.87 ALDH1A1 (0.52) HPGDALDH1A1HTTSMN1; SMN2TNKS
SCHEMBL31565265 0.87 MEN1 (0.51) HPGDALDH1A1HTTSMN1; SMN2RAB9A
SCHEMBL31565241 0.85 HTT (0.55) HPGDALDH1A1HTTSMN1; SMN2TNKS
SCHEMBL5452632 0.84 HPGD (0.55) HPGDALDH1A1HTTSMN1; SMN2RAB9A
SCHEMBL31565310 0.84 HTT (0.54) HPGDALDH1A1HTTSMN1; SMN2RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025091127-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF UNIVERSITE DE MONTREAL (CA) 2025-05-08 — — WO disclosed
Send feedback